Compound Identification
SMILES
[O-][N+](=O)OC(=O)CCC(=O)OC1=CC=CC=C1
InChIKey
InChIKey=BCTYKGGBUQMEQF-UHFFFAOYSA-N
Formula
C10H9NO6
Mass
239.183
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Phenol esters
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol esters
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenol esters
Alternative Parents
Phenoxy compounds Fatty acid esters Dicarboxylic acids and derivatives Acyl nitrates Organic nitro compounds Organic nitric acids and derivatives Carboxylic acid esters Organic salts Organic oxides Organic nitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenol ester - Phenoxy compound - Fatty acid ester - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Fatty acyl - Acyl nitrate - Organic nitrate - Organic nitric acid or derivatives - Carboxylic acid ester - Organic nitro compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carbonyl group - Organic salt - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenol esters. These are aromatic compounds containing a benzene ring substituted by a hydroxyl group and an ester group.
External Descriptors
Not available